2-[(2,4-dimethylphenyl)methylsulfanyl]-3-prop-2-enyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one
概要:2-[(2,4-dimethylphenyl)methylsulfanyl]-3-prop-2-enyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one(CAS 314042-09-6)是一种化学化合物,分子式为C22H24N2OS2,分子量为396.13 g/mol。河南科弘生物科技有限公司提供CRO/CDMO定制合成服务,支持克级到吨级规格。
2-[(2,4-dimethylphenyl)methylsulfanyl]-3-prop-2-enyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one
又称:2-[(2,4-dimethylphenyl)methylsulfanyl]-3-prop-2-enyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one, 3-allyl-2-[(2,4-dimethylbenzyl)sulfanyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one, 2-[(2,4-dimethylbenzyl)sulfanyl]-3-(prop-2-en-1-yl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one, 3-allyl-2-((2,4-dimethylbenzyl)thio)-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-4(3H)-one
| 分子式 | C22H24N2OS2 |
|---|---|
| 分子量 | 396.13 g/mol |
| LogP | 5.43194 |
| 拓扑极性表面积 | 34.89 Ų |
| 氢键供体数 | 0 |
| 氢键受体数 | 4 |
| 可旋转键数 | 5 |
| 精确质量 | 396.133 |
| 重原子数 | 27 |
| 复杂度 | 1078.0868 |
化学标识符
| CAS 编号 | 314042-09-6 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)CSC2=NC3=C(C4=C(S3)CCCC4)C(=O)N2CC=C)C |
产品概述
2-[(2,4-dimethylphenyl)methylsulfanyl]-3-prop-2-enyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one(CAS 314042-09-6),分子式为C22H24N2OS2,分子量为396.13 g/mol。IUPAC名:2-[(2,4-dimethylphenyl)methylsulfanyl]-3-prop-2-enyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one。
2-[(2,4-dimethylphenyl)methylsulfanyl]-3-prop-2-enyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one化学性质概览
属性洞察:2-[(2,4-dimethylphenyl)methylsulfanyl]-3-prop-2-enyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one
2-[(2,4-dimethylphenyl)methylsulfanyl]-3-prop-2-enyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one的XLogP值为5.43194,表明该化合物具有亲脂性(脂溶性好),可能影响其吸收、分布和配方策略。 2-[(2,4-dimethylphenyl)methylsulfanyl]-3-prop-2-enyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one的拓扑极性表面积(TPSA)为34.89 Ų,极性较低,可能具有较好的细胞膜透过性。 根据Lipinski五规则,2-[(2,4-dimethylphenyl)methylsulfanyl]-3-prop-2-enyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one有0个氢键供体和4个氢键受体,可能需要考虑配方优化。
常见问题
常见问题
2-[(2,4-dimethylphenyl)methylsulfanyl]-3-prop-2-enyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one的CAS号是多少?
2-[(2,4-dimethylphenyl)methylsulfanyl]-3-prop-2-enyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one的CAS号为314042-09-6。
2-[(2,4-dimethylphenyl)methylsulfanyl]-3-prop-2-enyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one的分子式是什么?
2-[(2,4-dimethylphenyl)methylsulfanyl]-3-prop-2-enyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one的分子式为C22H24N2OS2。
2-[(2,4-dimethylphenyl)methylsulfanyl]-3-prop-2-enyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one的分子量是多少?
2-[(2,4-dimethylphenyl)methylsulfanyl]-3-prop-2-enyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one的分子量为396.13 g/mol。
在哪里可以购买2-[(2,4-dimethylphenyl)methylsulfanyl]-3-prop-2-enyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one?
您可以直接向科弘生物询价2-[(2,4-dimethylphenyl)methylsulfanyl]-3-prop-2-enyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one。联系我们或发送邮件至info@kehongbio.com获取报价和库存信息。
科弘生物是否提供2-[(2,4-dimethylphenyl)methylsulfanyl]-3-prop-2-enyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one的定制合成服务?
是的,科弘生物提供2-[(2,4-dimethylphenyl)methylsulfanyl]-3-prop-2-enyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one及相关化合物的定制合成服务。请联系我们并告知您的具体需求,包括数量、纯度和交期。